pychum.engine.eon._dataclasses¶

Classes¶

`NWChemAtom`
`NWChemSocketConfig`

Module Contents¶

class pychum.engine.eon._dataclasses.NWChemAtom[source]¶

symbol: str[source]¶

x: float[source]¶

y: float[source]¶

z: float[source]¶

class pychum.engine.eon._dataclasses.NWChemSocketConfig[source]¶

atoms: list[NWChemAtom][source]¶

settings_path: pathlib.Path[source]¶

socket_address: str[source]¶

unix_mode: bool = False[source]¶

mem_in_gb: int = 2[source]¶

output_path: pathlib.Path[source]¶